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ECTO
Environmental Conditions, Treatments and Exposures Ontology
(ECTO)
OWL
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Last submission date April 10, 2024
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ID
http://purl.obolibrary.org/obo/CHEBI_5615
http://purl.obolibrary.org/obo/CHEBI_5615
https://agroportal.lirmm.fr/ontologies/ECTO/CHEBI_5615
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Preferred name
halothane
Synonyms
1-bromo-1-chloro-2,2,2-trifluoroethane
bromochlorotrifluoroethane
1,1,1-trifluoro-2-bromo-2-chloroethane
1,1,1-trifluoro-2-chloro-2-bromoethane
Phthorothanum
2-bromo-2-chloro-1,1,1-trifluoroethane
2,2,2-trifluoro-1-chloro-1-bromoethane
Fluothane
Rhodialothan
Narcotane
Halothane
Definitions
A haloalkane comprising ethane having three flouro substituents at the 1-position as well as bromo- and chloro substituents at the 2-position.
Raw data
obo_purl:RO_0000053
http://purl.obolibrary.org/obo/CHEBI_38870
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oboinowl_gen:inSubset
http://purl.obolibrary.org/obo/chebi#3_STAR
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obo_purl:smiles
[H]C(Cl)(Br)C(F)(F)F
obo_purl:charge
0
obo_purl:inchikey
BCQZXOMGPXTTIC-UHFFFAOYSA-N
obo_purl:RO_0000087
http://purl.obolibrary.org/obo/CHEBI_38870
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oboinowl_gen:hasDbXref
Wikipedia:Halothane
PMID:7519986
Beilstein:1736947
Gmelin:793752
VSDB:1806
KEGG:C07515
KEGG:D00542
Drug_Central:1356
DrugBank:DB01159
CAS:151-67-7
obo_purl:IAO_0000115
A haloalkane comprising ethane having three flouro substituents at the 1-position as well as bromo- and chloro substituents at the 2-position.
skos:notation
CHEBI:5615
oboinowl_gen:hasExactSynonym
2-bromo-2-chloro-1,1,1-trifluoroethane
Halothane
obo_purl:mass
197.38125
obo_purl:inchi
InChI=1S/C2HBrClF3/c3-1(4)2(5,6)7/h1H
obo_purl:formula
C2HBrClF3
oboinowl_gen:hasOBONamespace
chebi_ontology
rdf:type
http://www.w3.org/2002/07/owl#Class
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oboinowl_gen:hasRelatedSynonym
1-bromo-1-chloro-2,2,2-trifluoroethane
bromochlorotrifluoroethane
1,1,1-trifluoro-2-bromo-2-chloroethane
1,1,1-trifluoro-2-chloro-2-bromoethane
Phthorothanum
2-bromo-2-chloro-1,1,1-trifluoroethane
2,2,2-trifluoro-1-chloro-1-bromoethane
Fluothane
Rhodialothan
Narcotane
oboinowl_gen:id
CHEBI:5615
rdfs:label
halothane
obo_purl:monoisotopicmass
195.89022
rdfs:subClassOf
http://purl.obolibrary.org/obo/CHEBI_36683
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http://purl.obolibrary.org/obo/CHEBI_37141
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http://purl.obolibrary.org/obo/CHEBI_24469
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http://purl.obolibrary.org/obo/CHEBI_37143
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